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Benzoic acid, 5-[(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)methyl]-2-hydroxy-3-methyl-

View entire compound with spectra: 1 FTIR

Benzoic acid, 5-[(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)methyl]-2-hydroxy-3-methyl-
SpectraBase Compound ID LDo7ujGTkLO
InChI InChI=1S/C27H22N2O7/c1-13-9-16(11-19(23(13)30)26(33)34)22(17-10-14(2)24(31)20(12-17)27(35)36)21-15(3)28-29(25(21)32)18-7-5-4-6-8-18/h4-12,30,32H,1-3H3,(H,33,34)(H,35,36)/b22-17-
InChIKey HBFXAAPLVNHIRI-XLNRJJMWSA-N
Mol Weight 486.48 g/mol
Molecular Formula C27H22N2O7
Exact Mass 486.142701 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID Foe06b2kvDz
Name Benzoic acid, 5-[(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)methyl]-2-hydroxy-3-methyl-
CAS Registry Number 6411-50-3
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H22N2O7
InChI InChI=1S/C27H22N2O7/c1-13-9-16(11-19(23(13)30)26(33)34)22(17-10-14(2)24(31)20(12-17)27(35)36)21-15(3)28-29(25(21)32)18-7-5-4-6-8-18/h4-12,30,32H,1-3H3,(H,33,34)(H,35,36)/b22-17-
InChIKey HBFXAAPLVNHIRI-XLNRJJMWSA-N
Instrument Name Bruker IFS 85
Technique KBr-Pellet